(E)-N-(3-cyano-4,5-dimethylthiophen-2-yl)-3-(4-nitrophenyl)acrylamide
TL;DR: (E)-N-(3-cyano-4,5-dimethylthiophen-2-yl)-3-(4-nitrophenyl)acrylamide (CAS 551903-67-4) is a chemical compound with molecular formula C16H13N3O3S and molecular weight 327.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(E)-N-(3-cyano-4,5-dimethylthiophen-2-yl)-3-(4-nitrophenyl)prop-2-enamide
Also Known As: F2590-0048, (E)-N-(3-cyano-4,5-dimethylthiophen-2-yl)-3-(4-nitrophenyl)acrylamide, (E)-N-(3-cyano-4,5-dimethylthiophen-2-yl)-3-(4-nitrophenyl)prop-2-enamide, (2E)-N-(3-cyano-4,5-dimethylthiophen-2-yl)-3-(4-nitrophenyl)prop-2-enamide, N-(3-cyano-4,5-dimethyl-2-thienyl)-(E)-3-(p-nitrophenyl)acrylamide
| Molecular Formula | C16H13N3O3S |
|---|---|
| Molecular Weight | 327.07 g/mol |
| LogP | 3.79672 |
| Topological Polar Surface Area | 96.03 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 327.06775 |
| Heavy Atoms | 23 |
| Complexity | 829.4907 |
Chemical Identifiers
| CAS Number | 551903-67-4 |
|---|---|
| SMILES | CC1=C(SC(=C1C#N)NC(=O)/C=C/C2=CC=C(C=C2)[N+](=O)[O-])C |
Product Overview
(E)-N-(3-cyano-4,5-dimethylthiophen-2-yl)-3-(4-nitrophenyl)acrylamide (CAS 551903-67-4), with molecular formula C16H13N3O3S and molecular weight 327.07 g/mol. IUPAC: (E)-N-(3-cyano-4,5-dimethylthiophen-2-yl)-3-(4-nitrophenyl)prop-2-enamide.
Chemical Property Profile of (E)-N-(3-cyano-4,5-dimethylthiophen-2-yl)-3-(4-nitrophenyl)acrylamide
Property Insights of (E)-N-(3-cyano-4,5-dimethylthiophen-2-yl)-3-(4-nitrophenyl)acrylamide
The XLogP value of 3.79672 indicates that (E)-N-(3-cyano-4,5-dimethylthiophen-2-yl)-3-(4-nitrophenyl)acrylamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 96.03 Ų falls within the moderate polarity range, balancing permeability and solubility for (E)-N-(3-cyano-4,5-dimethylthiophen-2-yl)-3-(4-nitrophenyl)acrylamide. Following Lipinski's Rule of Five, (E)-N-(3-cyano-4,5-dimethylthiophen-2-yl)-3-(4-nitrophenyl)acrylamide has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of (E)-N-(3-cyano-4,5-dimethylthiophen-2-yl)-3-(4-nitrophenyl)acrylamide?
The CAS number of (E)-N-(3-cyano-4,5-dimethylthiophen-2-yl)-3-(4-nitrophenyl)acrylamide is 551903-67-4.
What is the molecular formula of (E)-N-(3-cyano-4,5-dimethylthiophen-2-yl)-3-(4-nitrophenyl)acrylamide?
The molecular formula of (E)-N-(3-cyano-4,5-dimethylthiophen-2-yl)-3-(4-nitrophenyl)acrylamide is C16H13N3O3S.
What is the molecular weight of (E)-N-(3-cyano-4,5-dimethylthiophen-2-yl)-3-(4-nitrophenyl)acrylamide?
The molecular weight of (E)-N-(3-cyano-4,5-dimethylthiophen-2-yl)-3-(4-nitrophenyl)acrylamide is 327.07 g/mol.
Where can I buy (E)-N-(3-cyano-4,5-dimethylthiophen-2-yl)-3-(4-nitrophenyl)acrylamide?
You can request a quote for (E)-N-(3-cyano-4,5-dimethylthiophen-2-yl)-3-(4-nitrophenyl)acrylamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (E)-N-(3-cyano-4,5-dimethylthiophen-2-yl)-3-(4-nitrophenyl)acrylamide?
Yes, KEHONG BIO provides custom synthesis services for (E)-N-(3-cyano-4,5-dimethylthiophen-2-yl)-3-(4-nitrophenyl)acrylamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.